N,2-dimethylpyrazole-3-sulfonamide

C5H9N3O2S — CID 112692806

IUPACN,2-dimethylpyrazole-3-sulfonamide
SMILESCNS(=O)(=O)c1ccnn1C
InChIInChI=1S/C5H9N3O2S/c1-6-11(9,10)5-3-4-7-8(5)2/h3-4,6H,1-2H3
InChIKeyBJWXKHZJBRCIMO-UHFFFAOYSA-N
MW175.21 g/mol
LogP-0.67
Rot. Bonds2

About N,2-dimethylpyrazole-3-sulfonamide

N,2-dimethylpyrazole-3-sulfonamide (PubChem CID 112692806) has the molecular formula C5H9N3O2S and a molecular weight of 175.21 g/mol. Its IUPAC name is N,2-dimethylpyrazole-3-sulfonamide.

Molecular Properties

Compound NameN,2-dimethylpyrazole-3-sulfonamide
PubChem CID112692806
Molecular FormulaC5H9N3O2S
Molecular Weight175.21 g/mol
Exact Mass175.04
IUPAC NameN,2-dimethylpyrazole-3-sulfonamide
SMILESCNS(=O)(=O)c1ccnn1C
InChIInChI=1S/C5H9N3O2S/c1-6-11(9,10)5-3-4-7-8(5)2/h3-4,6H,1-2H3
InChIKeyBJWXKHZJBRCIMO-UHFFFAOYSA-N
XLogP-0.67
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.21
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethylpyrazole-3-sulfonamide?
The IUPAC name of N,2-dimethylpyrazole-3-sulfonamide (CID 112692806) is N,2-dimethylpyrazole-3-sulfonamide.
What is the SMILES notation for N,2-dimethylpyrazole-3-sulfonamide?
The canonical SMILES for N,2-dimethylpyrazole-3-sulfonamide is CNS(=O)(=O)c1ccnn1C.
What is the InChIKey of N,2-dimethylpyrazole-3-sulfonamide?
The InChIKey is BJWXKHZJBRCIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2S/c1-6-11(9,10)5-3-4-7-8(5)2/h3-4,6H,1-2H3.
What are the key properties of N,2-dimethylpyrazole-3-sulfonamide?
N,2-dimethylpyrazole-3-sulfonamide has a molecular weight of 175.21 g/mol, XLogP of -0.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylpyrazole-3-sulfonamide is sourced from PubChem (CID 112692806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).